methyl 4-methyl-2-[2-(thiophen-2-ylcarbonylamino)ethanoyloxymethyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[2-(thiophen-2-ylcarbonylamino)ethanoyloxymethyl]quinoline-3-carboxylate Openeye Name: methyl 4-methyl-2-[[2-(thiophene-2-carbonylamino)acetyl]oxymethyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethoxy]methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[2-(thiophene-2-carbonylamino)acetyl]oxymethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[2-(2-thenoylamino)acetyl]oxymethyl]quinoline-3-carboxylic acid methyl ester Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CNC(=O)C3=CC=CS3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CNC(=O)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C20H18N2O5S/c1-12-13-6-3-4-7-14(13)22-15(18(12)20(25)26-2)11-27-17(23)10-21-19(24)16-8-5-9-28-16/h3-9H,10-11H2,1-2H3,(H,21,24)